Groupmeeting: Difference between revisions
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! Name !! from !! date !! time !! location || title | ! Name !! from !! date !! time !! location || title | ||
|- | |- | ||
| | | Flavio Siro Brigiano || VU Brussel || Tuesday, July-22-2021 || 11:00 || Zoom || Reactivity at aqueous interfaces by enhanced sampling MD simulations | ||
|- | |- | ||
| | | MSc Saba Ghasemlou || TCC || Tuesday, July-13-2021 || 11:00 || Zoom || Simulation of the phase transition in DL-methionine | ||
|- | |- | ||
| | | Erwan Privat || TCC || Tuesday, July-06-2021 || 11:00 || Zoom || Quantum dynamics of the oxygen isotopic exchange: lifetimes of metastable states of the ozone intermediate complex | ||
|- | |- | ||
| | | Fabian Berger || HU Berlin || Tuesday, June-29-2021 || 11:00 || Zoom || MD Simulations with Chemical Accuracy - Adsorption in Zeolites | ||
|- | |- | ||
| | | Daria Galimberti || TCC || Tuesday, June-22-2021 || 11:00 || Zoom || Vibrational specrtra from MD simulations: strengths and weaknesses | ||
|- | |- | ||
| Mattew D. Frye | | Lieke Geessinck || TCC || Tuesday, June-15-2021 || 11:00 || Zoom || Potential energy surfaces of the tagged Renner Teller ion C<sub>2</sub>H<sup>+</sup> | ||
|- | |||
| Mattew D. Frye || Durham University || Tuesday, June-08-2021 || 11:00 || Zoom || tba | |||
|- | |- | ||
| Prof. Herma Cuppen | | Prof. Herma Cuppen || TCC || Tuesday, June-01-2021 || 11:00 || Zoom || tba | ||
|- | |- | ||
| MSc Kim Steenbakkers || FELIX+TCC || Tuesday, May-25-2021 || 11:00 || Zoom || Elucidation of Renner-Teller and spin-orbit splitting patterns for Ne-C<sub>2</sub>H<sup>+</sup> weakly bound complex | | MSc Kim Steenbakkers || FELIX+TCC || Tuesday, May-25-2021 || 11:00 || Zoom || Elucidation of Renner-Teller and spin-orbit splitting patterns for Ne-C<sub>2</sub>H<sup>+</sup> weakly bound complex | ||
|- | |- | ||
|} | |} | ||
== Preliminary schedule, subject to change == | == Preliminary schedule, subject to change == | ||
* July 20 Flavio Siro Brigiano (VU Brussel) | * July 20 Flavio Siro Brigiano (VU Brussel) | ||
* Aug 31 Gerrit / volunteer? | * Aug 31 Gerrit / volunteer? | ||
Revision as of 07:48, 15 July 2021
Group meeting schedule Theoretical and Computational Chemistry
| Name | from | date | time | location | title |
|---|---|---|---|---|---|
| Flavio Siro Brigiano | VU Brussel | Tuesday, July-22-2021 | 11:00 | Zoom | Reactivity at aqueous interfaces by enhanced sampling MD simulations |
| MSc Saba Ghasemlou | TCC | Tuesday, July-13-2021 | 11:00 | Zoom | Simulation of the phase transition in DL-methionine |
| Erwan Privat | TCC | Tuesday, July-06-2021 | 11:00 | Zoom | Quantum dynamics of the oxygen isotopic exchange: lifetimes of metastable states of the ozone intermediate complex |
| Fabian Berger | HU Berlin | Tuesday, June-29-2021 | 11:00 | Zoom | MD Simulations with Chemical Accuracy - Adsorption in Zeolites |
| Daria Galimberti | TCC | Tuesday, June-22-2021 | 11:00 | Zoom | Vibrational specrtra from MD simulations: strengths and weaknesses |
| Lieke Geessinck | TCC | Tuesday, June-15-2021 | 11:00 | Zoom | Potential energy surfaces of the tagged Renner Teller ion C2H+ |
| Mattew D. Frye | Durham University | Tuesday, June-08-2021 | 11:00 | Zoom | tba |
| Prof. Herma Cuppen | TCC | Tuesday, June-01-2021 | 11:00 | Zoom | tba |
| MSc Kim Steenbakkers | FELIX+TCC | Tuesday, May-25-2021 | 11:00 | Zoom | Elucidation of Renner-Teller and spin-orbit splitting patterns for Ne-C2H+ weakly bound complex |
Preliminary schedule, subject to change
- July 20 Flavio Siro Brigiano (VU Brussel)
- Aug 31 Gerrit / volunteer?
- Sept 7 Gilles / volunteer?
- Sept 14 External speaker
- Sept 21 MSc Mart Simons
- Sept 28 MSc Matthieu Besemer
- Oct 5 External speaker
- Oct 12 MSc Taha Selim
- Oct 19 Daria / volunteer?
- Oct 26 External speaker
- Nov 2 MSc Marijn Man
- Nov 9 Gilles / volunteer?
- Nov 16 External speaker
- Nov 23 MSc Saba Ghasemlou
- Nov 30 Gijs / volunteer?
- Dec 7 External speaker
- Dec 14 MSc Taha Selim
- Dec 21 Ad / volunteer?
